(Q105155227)

English

methyl (1S,4aR,5S,8aR)-5-[(Z)-5-hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylate

chemical compound

In more languages

Statements

type of chemical entity

0 references

methyl 5-(5-hydroxy-3-methylpent-3-enyl)-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylate

1 reference

based on heuristic

inferred from SMILES

334.250794948 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

methyl (1S,4aR,5S,8aS)-5-[(E)-5-hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(13E)-15-Hydroxylabda-8(20),13-dien-19-oic acid methyl ester

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₁H₃₄O₃

0 references

canonical SMILES

O=C(OC)C1(C)CCCC2(C)C(C(=C)CCC12)CCC(=CCO)C

0 references

isomeric SMILES

C=C1CC[C@H]2[C@@](C)(C(=O)OC)CCC[C@]2(C)[C@H]1CC/C(C)=C\CO

0 references

Cryptomeria japonica

1 reference

Labdanes from Cryptomeria japonica

Identifiers

InChI=1S/C21H34O3/c1-15(11-14-22)7-9-17-16(2)8-10-18-20(17,3)12-6-13-21(18,4)19(23)24-5/h11,17-18,22H,2,6-10,12-14H2,1,3-5H3/b15-11-/t17-,18+,20+,21-/m0/s1

0 references

LPLVHEIZIMARCP-AKJFJKTASA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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